Log in
Browse 
Membranes
Search
Statistics
Lab
Documentation2,3,3-trifluoropropanal
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM01626 |
| SMILES |
O=CC(F)C(F)F
|
| InChIKey |
GZQNBSRKMRMCMQ-UHFFFAOYSA-N
|
| MW [Da] |
112.05
Automatically obtained from RDkit software. |
| LogP |
0.79
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
22049856
|
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM103292
Similarity: 0.7288
Similarity to MM103292
| Tanimoto metric | 0.7288 |
|---|---|
| Cosine metric | 0.8537 |
| Dice metric | 0.8431 |
| MW: | 130.04 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM24498
Similarity: 0.6977
Similarity to MM24498
| Tanimoto metric | 0.6977 |
|---|---|
| Cosine metric | 0.8353 |
| Dice metric | 0.8219 |
| MW: | 94.06 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM01625
Similarity: 0.6232
Similarity to MM01625
| Tanimoto metric | 0.6232 |
|---|---|
| Cosine metric | 0.7894 |
| Dice metric | 0.7679 |
| MW: | 126.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+114 more
